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canSAR2017727
FEATURES
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NAMES
    SMILES
    Cc1c(C(=O)OCC(=O)NC2CC2)oc2ccc(Br)cc12
    InChI
    InChI=1S/C15H14BrNO4/c1-8-11-6-9(16)2-5-12(11)21-14(8)15(19)20-7-13(18)17-10-3-4-10/h2,5-6,10H,3-4,7H2,1H3,(H,17,18)
    MOLECULAR FORMULA
    C15H14BrNO4
    CROSS REFERENCES
    2017727 logo

    canSAR2017727

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 351.01
    AlogP 2.94
    HBond donors 1
    HBond acceptors 5
    Atoms 35
    Contains toxicophore No
    Contains PAINS No
    Commercially available Yes
    Property color indications are based on Lipinski's Ro5.
    PROTEIN TARGETS
    No information about proteins targeted by canSAR2017727.